8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,3-dimethylbutanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Chemical Structure Depiction of
8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,3-dimethylbutanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,3-dimethylbutanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione
Compound characteristics
| Compound ID: | SC88-2123 |
| Compound Name: | 8-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-(3,3-dimethylbutanoyl)-5lambda~6~-thia-2-azaspiro[3.4]octane-5,5-dione |
| Molecular Weight: | 437.94 |
| Molecular Formula: | C20 H24 Cl N3 O4 S |
| Smiles: | CC(C)(C)CC(N1CC2(C1)C(CCS2(=O)=O)c1nc(c2ccc(cc2)[Cl])no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1896 |
| logD: | 4.1896 |
| logSw: | -4.55 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.047 |
| InChI Key: | IPVCIUQJDPYAIO-OAHLLOKOSA-N |